Geometry & MOs

Info

ID:	414257
PubChem CID:	135087213
Reduced:	O4N5C18H23 (1)
Stoich.:	A4B5C18D23 (1)
Weight, g/mol:	312.183778
ΔH_f, kcal/mol:	-71.91
Dipole, Da:	4.35
IP(EA), eV:	-9.22(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]-2-indol-1-ylethanone

Drug info:

PubChemData

Smile

CC1=NOC(=C1)C[C@@H]2CN(C[C@H]2O)C3=NC(=CN=C3)C(=O)N4CCOCC4

DOS

IR

Vibrations